2-(2-bromanyl-4,6-dimethyl-phenoxy)-N-(3-chloranyl-4-pyrrolidin-1-yl-phenyl)ethanamide

Systemtic Name: 2-(2-bromanyl-4,6-dimethyl-phenoxy)-N-(3-chloranyl-4-pyrrolidin-1-yl-phenyl)ethanamide Openeye Name: 2-(2-bromo-4,6-dimethyl-phenoxy)-N-(3-chloro-4-pyrrolidin-1-yl-phenyl)acetamide CAS Name: 2-(2-bromo-4,6-dimethylphenoxy)-N-[3-chloro-4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(2-bromo-4,6-dimethylphenoxy)-N-(3-chloro-4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-(2-bromo-4,6-dimethyl-phenoxy)-N-(3-chloro-4-pyrrolidino-phenyl)acetamide Formula: C20H22BrClN2O2 MolecularWeight: 437.75788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC(=C(C=C2)N3CCCC3)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC(=C(C=C2)N3CCCC3)Cl)C

InChI

InChI=1S/C20H22BrClN2O2/c1-13-9-14(2)20(16(21)10-13)26-12-19(25)23-15-5-6-18(17(22)11-15)24-7-3-4-8-24/h5-6,9-11H,3-4,7-8,12H2,1-2H3,(H,23,25)